EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:183069 - Panicein C

ChEBI IDCHEBI:183069
ChEBI NamePanicein C
Stars
Last Modified22 August 2023
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24O5
Net Charge0
Average Mass356.418
Monoisotopic Mass356.16237
SMILESC/C(=C\Cc1cc(O)ccc1O)CCc1c(C)c(O)c(O)c(C=O)c1C
InChIInChI=1S/C21H24O5/c1-12(4-6-15-10-16(23)7-9-19(15)24)5-8-17-13(2)18(11-22)21(26)20(25)14(17)3/h4,7,9-11,23-26H,5-6,8H2,1-3H3/b12-4+
InChIKeyKTKUNEUPWDRROX-UUILKARUSA-N
Species of MetaboliteComponentSourceComments
Haliclona mucosa (ncbitaxon:608209) Whole Organism (NCIT:C13413) MetaboLights (MTBLS638)
ChEBI Ontology
Outgoing Relation(s)
Panicein C (CHEBI:183069) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
5-[(E)-5-(2,5-dihydroxyphenyl)-3-methylpent-3-enyl]-2,3-dihydroxy-4,6-dimethylbenzaldehyde
Manual XrefsDatabases
4578359ChemSpider